Vitas-M small molecule compound
methyl 4-[(4-chloro-3,5-dimethylphenoxy)acetyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Catalog ID
STK882319
SMILES COC(=O)C1Oc2ccccc2N(C1)C(=O)COc1cc(C)c(c(c1)C)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H20ClNO5 MW 389.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO5/c1-12-8-14(9-13(2)19(12)21)26-11-18(23)22-10-17(20(24)25-3)27-16-7-5-4-6-15(16)22/h4-9,17H,10-11H2,1-3H3InChIKey
ZJECGUAIFNIYTM-UHFFFAOYSA-NSynonyms
881445-25-6881445256
CC1=CC(=CC(=C1Cl)C)OCC(=O)N2CC(OC3=CC=CC=C32)C(=O)OC
InChI=1SC20H20ClNO5c112814(913(2)19(12)21)261118(23)221017(20(24)253)2716754615(16)22h4917H1011H213H3
methyl4((4chloro35dimethylphenoxy)acetyl)34dihydro2H14benzoxazine2carboxylate
methyl4(2(4chloro35dimethylphenoxy)acetyl)23dihydro14benzoxazine2carboxylate
MFCD06651310
ZINC000006810848
ZINC000006810849
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